- InChI
- InChI=1S/C7H5ClO3/c8-6-3-1-2-5(4-6)7(9)11-10/h1-4,10H
- InChI Key
- NHQDETIJWKXCTC-UHFFFAOYSA-N
- Formula
- C7H5ClO3
- SMILES
- O=C(OO)c1cccc(Cl)c1
- Molecular Weight1
- 172.57
- CAS
- 937-14-4
- Other Names
-
- m-Chloroperbenzoic acid
- Benzenecarboperoxoic acid, 3-chloro-
- m-Chlorobenzoyl hydroperoxide
- m-Chloroperoxybenzoic acid
- Perbenzoic acid, m-chloro-
- Peroxybenzoic acid, m-chloro-
- 3-Chloroperoxybenzoic acid
- UN 2755
- MCPBA
- NSC 97094
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -271.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -375.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.33 | kJ/mol | Joback Calculated Property |
| log10WS | -2.29 | Crippen Calculated Property | |
| logPoct/wat | 1.970 | Crippen Calculated Property | |
| McVol | 111.280 | ml/mol | McGowan Calculated Property |
| Pc | 4608.87 | kPa | Joback Calculated Property |
| Tboil | 597.12 | K | Joback Calculated Property |
| Tc | 809.71 | K | Joback Calculated Property |
| Tfus | 370.49 | K | Joback Calculated Property |
| Vc | 0.411 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [234.09; 272.47] | J/mol×K | [597.12; 809.71] | 
|
| Cp,gas | 234.09 | J/mol×K | 597.12 | Joback Calculated Property |
| Cp,gas | 241.65 | J/mol×K | 632.55 | Joback Calculated Property |
| Cp,gas | 248.74 | J/mol×K | 667.98 | Joback Calculated Property |
| Cp,gas | 255.36 | J/mol×K | 703.41 | Joback Calculated Property |
| Cp,gas | 261.51 | J/mol×K | 738.85 | Joback Calculated Property |
| Cp,gas | 267.22 | J/mol×K | 774.28 | Joback Calculated Property |
| Cp,gas | 272.47 | J/mol×K | 809.71 | Joback Calculated Property |
| η | [0.0000947; 0.0025401] | Pa×s | [370.49; 597.12] |
|
| η | 0.0025401 | Pa×s | 370.49 | Joback Calculated Property |
| η | 0.0011393 | Pa×s | 408.26 | Joback Calculated Property |
| η | 0.0005853 | Pa×s | 446.03 | Joback Calculated Property |
| η | 0.0003336 | Pa×s | 483.81 | Joback Calculated Property |
| η | 0.0002063 | Pa×s | 521.58 | Joback Calculated Property |
| η | 0.0001361 | Pa×s | 559.35 | Joback Calculated Property |
| η | 0.0000947 | Pa×s | 597.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Chloroperbenzoic acid.
Sources
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